ethoxy-dimethyl-(propyldisulfanyl)silane

C7H18OS2Si — CID 87557243

IUPACethoxy-dimethyl-(propyldisulfanyl)silane
SMILESCCCSS[Si](C)(C)OCC
InChIInChI=1S/C7H18OS2Si/c1-5-7-9-10-11(3,4)8-6-2/h5-7H2,1-4H3
InChIKeyFPTAJPFWUMFWMK-UHFFFAOYSA-N
MW210.44 g/mol
LogP3.52
Rot. Bonds6

About ethoxy-dimethyl-(propyldisulfanyl)silane

ethoxy-dimethyl-(propyldisulfanyl)silane (PubChem CID 87557243) has the molecular formula C7H18OS2Si and a molecular weight of 210.44 g/mol. Its IUPAC name is ethoxy-dimethyl-(propyldisulfanyl)silane.

Molecular Properties

Compound Nameethoxy-dimethyl-(propyldisulfanyl)silane
PubChem CID87557243
Molecular FormulaC7H18OS2Si
Molecular Weight210.44 g/mol
Exact Mass210.06
IUPAC Nameethoxy-dimethyl-(propyldisulfanyl)silane
SMILESCCCSS[Si](C)(C)OCC
InChIInChI=1S/C7H18OS2Si/c1-5-7-9-10-11(3,4)8-6-2/h5-7H2,1-4H3
InChIKeyFPTAJPFWUMFWMK-UHFFFAOYSA-N
XLogP3.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.44
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethoxy-dimethyl-(propyldisulfanyl)silane?
The IUPAC name of ethoxy-dimethyl-(propyldisulfanyl)silane (CID 87557243) is ethoxy-dimethyl-(propyldisulfanyl)silane.
What is the SMILES notation for ethoxy-dimethyl-(propyldisulfanyl)silane?
The canonical SMILES for ethoxy-dimethyl-(propyldisulfanyl)silane is CCCSS[Si](C)(C)OCC.
What is the InChIKey of ethoxy-dimethyl-(propyldisulfanyl)silane?
The InChIKey is FPTAJPFWUMFWMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18OS2Si/c1-5-7-9-10-11(3,4)8-6-2/h5-7H2,1-4H3.
What are the key properties of ethoxy-dimethyl-(propyldisulfanyl)silane?
ethoxy-dimethyl-(propyldisulfanyl)silane has a molecular weight of 210.44 g/mol, XLogP of 3.52, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-dimethyl-(propyldisulfanyl)silane is sourced from PubChem (CID 87557243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).